CID 56698929

Tert-butyl n-[(hydrazinecarbonyl)methyl]-n-methylcarbamate

Structural Information

Molecular Formula
C8H17N3O3
SMILES
CC(C)(C)OC(=O)N(C)CC(=O)NN
InChI
InChI=1S/C8H17N3O3/c1-8(2,3)14-7(13)11(4)5-6(12)10-9/h5,9H2,1-4H3,(H,10,12)
InChIKey
VQWBYKYBNLFIPX-UHFFFAOYSA-N
Compound name
tert-butyl N-(2-hydrazinyl-2-oxoethyl)-N-methylcarbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

68
Patents

203.127 Da
Monoisotopic Mass

-0.3
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 204.134276 146.7
[M+Na]+ 226.116218 151.4
[M-H]- 202.119724 148.0
[M+NH4]+ 221.160823 165.4
[M+K]+ 242.090158 153.4
[M+H-H2O]+ 186.124260 140.8
[M+HCOO]- 248.125201 170.4
[M+CH3COO]- 262.140851 194.5
[M+Na-2H]- 224.101666 149.9
[M]+ 203.12645142 147.2
[M]- 203.12754858 147.2
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

No literature data available for this compound.

Patent stripe

patents stripe