CID 146049653

2413864-26-1

Structural Information

Molecular Formula
C14H19NO
SMILES
C1[C@H]2CC([C@H]2CC1OCC3=CC=CC=C3)N
InChI
InChI=1S/C14H19NO/c15-14-7-11-6-12(8-13(11)14)16-9-10-4-2-1-3-5-10/h1-5,11-14H,6-9,15H2/t11-,12?,13-,14?/m0/s1
InChIKey
PKZSNCYRHNOSQL-AHPWVWPOSA-N
Compound name
(1R,5S)-3-phenylmethoxybicyclo[3.2.0]heptan-6-amine
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

0
Patents

217.14667 Da
Monoisotopic Mass

1.9
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 218.153946 145.3
[M+Na]+ 240.135888 150.1
[M-H]- 216.139394 151.9
[M+NH4]+ 235.180493 159.7
[M+K]+ 256.109828 149.8
[M+H-H2O]+ 200.143930 134.0
[M+HCOO]- 262.144871 166.3
[M+CH3COO]- 276.160521 193.9
[M+Na-2H]- 238.121336 148.3
[M]+ 217.14612142 151.4
[M]- 217.14721858 151.4
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

No patent data available for this compound.