CID 11056751

Bis(cyclohexylsulfonyl)diazomethane

Structural Information

Molecular Formula
C13H22N2O4S2
SMILES
C1CCC(CC1)S(=O)(=O)C(=[N+]=[N-])S(=O)(=O)C2CCCCC2
InChI
InChI=1S/C13H22N2O4S2/c14-15-13(20(16,17)11-7-3-1-4-8-11)21(18,19)12-9-5-2-6-10-12/h11-12H,1-10H2
InChIKey
GLGXSTXZLFQYKJ-UHFFFAOYSA-N
Compound name
[cyclohexylsulfonyl(diazo)methyl]sulfonylcyclohexane
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

10613
Patents

334.1021 Da
Monoisotopic Mass

3.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 335.10938 173.8
[M+Na]+ 357.09132 174.1
[M-H]- 333.09482 178.4
[M+NH4]+ 352.13592 186.2
[M+K]+ 373.06526 165.1
[M+H-H2O]+ 317.09936 171.1
[M+HCOO]- 379.10030 180.9
[M+CH3COO]- 393.11595 196.6
[M+Na-2H]- 355.07677 178.0
[M]+ 334.10155 164.2
[M]- 334.10265 164.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

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