CID 21061511

479079-15-7

Structural Information

Molecular Formula
C7H15N3O3
SMILES
CC(C)(C)OC(=O)NC/C(=N/O)/N
InChI
InChI=1S/C7H15N3O3/c1-7(2,3)13-6(11)9-4-5(8)10-12/h12H,4H2,1-3H3,(H2,8,10)(H,9,11)
InChIKey
HPWSTQITVJEUMH-UHFFFAOYSA-N
Compound name
tert-butyl N-[(2Z)-2-amino-2-hydroxyiminoethyl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

114
Patents

189.11134 Da
Monoisotopic Mass

0.1
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 190.11862 142.3
[M+Na]+ 212.10056 147.1
[M-H]- 188.10406 142.2
[M+NH4]+ 207.14516 160.8
[M+K]+ 228.07450 147.9
[M+H-H2O]+ 172.10860 136.6
[M+HCOO]- 234.10954 165.7
[M+CH3COO]- 248.12519 188.1
[M+Na-2H]- 210.08601 146.6
[M]+ 189.11079 141.1
[M]- 189.11189 141.1
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