CID 71744123

1158759-94-4

Structural Information

Molecular Formula
C11H22N2O3
SMILES
CC(C)(C)OC(=O)NC1(CCOCC1)CN
InChI
InChI=1S/C11H22N2O3/c1-10(2,3)16-9(14)13-11(8-12)4-6-15-7-5-11/h4-8,12H2,1-3H3,(H,13,14)
InChIKey
BGPVAGINRNAFSY-UHFFFAOYSA-N
Compound name
tert-butyl N-[4-(aminomethyl)oxan-4-yl]carbamate
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

30
Patents

230.16304 Da
Monoisotopic Mass

0.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 231.17032 154.4
[M+Na]+ 253.15226 157.7
[M-H]- 229.15576 157.1
[M+NH4]+ 248.19686 172.0
[M+K]+ 269.12620 158.7
[M+H-H2O]+ 213.16030 149.0
[M+HCOO]- 275.16124 172.7
[M+CH3COO]- 289.17689 191.8
[M+Na-2H]- 251.13771 160.1
[M]+ 230.16249 151.5
[M]- 230.16359 151.5
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