SDBS-MS2001-00094WA
Title
SDBS-MS2001-00094WA
Subtitle
MS spectrum of 2,2,2-trichloroethyl 3,3-dimethyl-7-oxo-6-phenylacetamido-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate 4-oxide
Type
data
Subject
Spectral data
Spectral Code
MS2001-00094WA
DOI

URL
https://sdbs.db.aist.go.jp/sdbs/cgi-bin/landingpage?spcode=MS2001-00094WA
Description
Spectral Type
MS
Sample: Compound Name
2,2,2-trichloroethyl 3,3-dimethyl-7-oxo-6-phenylacetamido-4-thia-1-azabicyclo(3.2.0)heptane-2-carboxylate 4-oxide
Sample: Molecular Formula
C18H19Cl3N2O5S
Sample: Molecular Weight
481.8
Sample: SDBS No
408
Sample: InChI
InChI=1S/C18H19Cl3N2O5S/c1-17(2)13(16(26)28-9-18(19,20)21)23-14(25)12(15(23)29(17)27)22-11(24)8-10-6-4-3-5-7-10/h3-7,12-13,15H,8-9H2,1-2H3,(H,22,24)/t12-,13+,15-,29?/m1/s1
Sample: InChIKey
YAAZDVWYKQUGLX-TVLWPHTOSA-N
Sample: RN
39879-59-9
Measurement Conditions
Source Temperature: 205 °C
Sample Temperature:  65 °C
Direct, 70 eV
Related pages
Collection of Spectral data SDBS-408
IR SDBS-IR-NIDA-44348
IR SDBS-IR-NIDA-45654
Publisher
National Institute of Advanced Industrial Science and Technology (AIST)
Rights
AIST all rights reserved
Date of Publication
2003-09-30
Update History


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