CID 22014528

39512-63-5

Structural Information

Molecular Formula
C7H11N3O3
SMILES
CC(C)(C)OC(=O)NC1=NOC=N1
InChI
InChI=1S/C7H11N3O3/c1-7(2,3)13-6(11)9-5-8-4-12-10-5/h4H,1-3H3,(H,9,10,11)
InChIKey
REWQNYFPXZTNHQ-UHFFFAOYSA-N
Compound name
tert-butyl N-(1,2,4-oxadiazol-3-yl)carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

35
Patents

185.08005 Da
Monoisotopic Mass

1.0
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 186.08733 138.8
[M+Na]+ 208.06927 146.6
[M-H]- 184.07277 140.8
[M+NH4]+ 203.11387 156.2
[M+K]+ 224.04321 147.9
[M+H-H2O]+ 168.07731 132.0
[M+HCOO]- 230.07825 160.6
[M+CH3COO]- 244.09390 179.9
[M+Na-2H]- 206.05472 146.5
[M]+ 185.07950 141.7
[M]- 185.08060 141.7
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