CID 10558886

3-(tert-butoxy)piperidine hydrochloride

Structural Information

Molecular Formula
C9H19NO
SMILES
CC(C)(C)OC1CCCNC1
InChI
InChI=1S/C9H19NO/c1-9(2,3)11-8-5-4-6-10-7-8/h8,10H,4-7H2,1-3H3
InChIKey
RSMXSKJUTTWWLA-UHFFFAOYSA-N
Compound name
3-[(2-methylpropan-2-yl)oxy]piperidine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

41
Patents

157.14667 Da
Monoisotopic Mass

1.2
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 158.15395 138.5
[M+Na]+ 180.13589 142.9
[M-H]- 156.13939 138.3
[M+NH4]+ 175.18049 157.4
[M+K]+ 196.10983 141.7
[M+H-H2O]+ 140.14393 132.8
[M+HCOO]- 202.14487 154.5
[M+CH3COO]- 216.16052 174.1
[M+Na-2H]- 178.12134 143.8
[M]+ 157.14612 133.6
[M]- 157.14722 133.6
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