CID 87183

Z-d-phg-oh

Structural Information

Molecular Formula
C16H15NO4
SMILES
C1=CC=C(C=C1)COC(=O)N[C@H](C2=CC=CC=C2)C(=O)O
InChI
InChI=1S/C16H15NO4/c18-15(19)14(13-9-5-2-6-10-13)17-16(20)21-11-12-7-3-1-4-8-12/h1-10,14H,11H2,(H,17,20)(H,18,19)/t14-/m1/s1
InChIKey
RLDJWBVOZVJJOS-CQSZACIVSA-N
Compound name
(2R)-2-phenyl-2-(phenylmethoxycarbonylamino)acetic acid
Related CIDs

2D Structure

compound 2d structure
1
Annotation Hits

0
References

311
Patents

285.1001 Da
Monoisotopic Mass

2.7
XlogP (predicted)

Profile

Predicted Collision Cross Section

Adduct m/z Predicted CCS (Ų)
[M+H]+ 286.10738 165.5
[M+Na]+ 308.08932 176.4
[M+NH4]+ 303.13392 171.7
[M+K]+ 324.06326 171.2
[M-H]- 284.09282 168.1
[M+Na-2H]- 306.07477 172.7
[M]+ 285.09955 167.5
[M]- 285.10065 167.5
m/z: mass to charge ratio of the adduct.
Predicted Collision Cross Section (CCS) values (Ų) per adduct calculated using CCSbase.

Literature stripe

literature stripe

Patent stripe

patents stripe